N-[1-[3-(3-chloranyl-4-fluoranyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-3-cyclopentyl-N-phenethyl-propanamide

Systemtic Name: N-[1-[3-(3-chloranyl-4-fluoranyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-3-cyclopentyl-N-phenethyl-propanamide Openeye Name: N-[1-[3-(3-chloro-4-fluoro-phenyl)-4-oxo-quinazolin-2-yl]propyl]-3-cyclopentyl-N-phenethyl-propanamide CAS Name: N-[1-[3-(3-chloro-4-fluorophenyl)-4-oxo-2-quinazolinyl]propyl]-3-cyclopentyl-N-phenethylpropanamide IUPAC Name: N-[1-[3-(3-chloro-4-fluorophenyl)-4-oxoquinazolin-2-yl]propyl]-3-cyclopentyl-N-phenethylpropanamide Traditional Name: N-[1-[3-(3-chloro-4-fluoro-phenyl)-4-keto-quinazolin-2-yl]propyl]-3-cyclopentyl-N-phenethyl-propionamide Formula: C33H35ClFN3O2 MolecularWeight: 560.101303

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)F)Cl)N(CCC4=CC=CC=C4)C(=O)CCC5CCCC5

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)F)Cl)N(CCC4=CC=CC=C4)C(=O)CCC5CCCC5

InChI

InChI=1S/C33H35ClFN3O2/c1-2-30(37(21-20-24-10-4-3-5-11-24)31(39)19-16-23-12-6-7-13-23)32-36-29-15-9-8-14-26(29)33(40)38(32)25-17-18-28(35)27(34)22-25/h3-5,8-11,14-15,17-18,22-23,30H,2,6-7,12-13,16,19-21H2,1H3